Chem
J-GLOBAL ID:200907074250330867   Nikkaji number:J952.724I

Ochratoxin hydroquinone

オクラトキシンヒドロキノン
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C20H19NO7
Molecular formula furigana: C20-H19-N-O7
Molecular weight: 385.372
InChI: InChI=1S/C20H19NO7/c1-10-7-12-15(22)9-13(17(23)16(12)20(27)28-10)18(24)21-14(19(25)26)8-11-5-3-2-4-6-11/h2-6,9-10,14,22-23H,7-8H2,1H3,(H,21,24)(H,25,26)/t10-,14+/m1/s1
InChI key: HRZQKELUAUGJHJ-YGRLFVJLSA-N
SMILES: C[C@@H]1Cc2c(O)cc(C(=O)N[C@@H](Cc3ccccc3)C(=O)O)c(O)c2C(=O)O1
Systematic name  (5):
  • N-[[(3R)-1-オキソ-3α-メチル-5,8-ジヒドロキシ-3,4-ジヒドロ-1H-2-ベンゾピラン]-7-イルカルボニル]-L-フェニルアラニン
  • N-[[[(R)-3,4-ジヒドロ-5,8-ジヒドロキシ-3-メチル-1-オキソ-1H-2-ベンゾピラン]-7-イル]カルボニル]-L-フェニルアラニン
  • N-[[(3R)-1-オキソ-3-メチル-5,8-ジヒドロキシ-3,4-ジヒドロ-1H-2-ベンゾピラン-7-イル]カルボニル]-L-フェニルアラニン
  • (2S)-2-{[(3R)-5,8-ジヒドロキシ-3-メチル-1-オキソ-3,4-ジヒドロ-1H-2-ベンゾピラン-7-イル]ホルムアミド}-3-フェニルプロパン酸
  • (2S)-2-{[(3R)-5,8-dihydroxy-3-methyl-1-oxo-3,4-dihydro-1H-2-benzopyran-7-yl]formamido}-3-phenylpropanoic acid
Other name (5):
  • N-[[(3R)-1-Oxo-3α-methyl-5,8-dihydroxy-3,4-dihydro-1H-2-benzopyran]-7-ylcarbonyl]-L-phenylalanine
  • N-[[[(R)-3,4-Dihydro-5,8-dihydroxy-3-methyl-1-oxo-1H-2-benzopyran]-7-yl]carbonyl]-L-phenylalanine
  • オクラトキシンヒドロキノン
  • Ochratoxin hydroquinone
  • N-[[(3R)-1-Oxo-3-methyl-5,8-dihydroxy-3,4-dihydro-1H-2-benzopyran-7-yl]carbonyl]-L-phenylalanine
Thsaurus map:

Return to Previous Page